NK-611

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H37NO12.ClH
Molecular Weight	652.086
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 10
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[H][C@]12COC(=O)[C@]1([H])[C@H](C3=CC(OC)=C(O)C(OC)=C3)C4=CC5=C(OCO5)C=C4[C@H]2O[C@]6([H])O[C@]7([H])CO[C@@H](C)O[C@@]7([H])[C@H](O)[C@H]6N(C)C

InChI

InChIKey=PYLTTZZOZBYUEI-YRQLFVATSA-N

InChI=1S/C31H37NO12.ClH/c1-13-38-11-22-29(42-13)27(34)25(32(2)3)31(43-22)44-28-16-9-19-18(40-12-41-19)8-15(16)23(24-17(28)10-39-30(24)35)14-6-20(36-4)26(33)21(7-14)37-5;/h6-9,13,17,22-25,27-29,31,33-34H,10-12H2,1-5H3;1H/t13-,17+,22-,23-,24+,25-,27-,28-,29-,31+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C31H37NO12
Molecular Weight	615.625
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	10 / 10
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:37:55 GMT 2023` Edited by `admin` on `Sat Dec 16 16:37:55 GMT 2023`
Record UNII	6A2DAQ3ZZW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NK-611

Code

English

FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, 9-((2-DEOXY-2-(DIMETHYLAMINO)-4,6-O-(1R)-ETHYLIDENE-.BETA.-D-GLUCOPYRANOSYL)OXY)-5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-, HYDROCHLORIDE (1:1), (5R,5AR,8AR,9S)-

Systematic Name

English

NK 611

Code

English

VP-19 HYDROCHLORIDE

Code

English

2'-DIMETHYLAMINO-2'-DEOXYETOPOSIDE HYDROCHLORIDE

Common Name

English

VP 19 HYDROCHLORIDE

Code

English

Code System Code Type Description

FDA UNII

6A2DAQ3ZZW

Created by admin on Sat Dec 16 16:37:55 GMT 2023 , Edited by admin on Sat Dec 16 16:37:55 GMT 2023

PRIMARY

EPA CompTox

DTXSID90873361

Created by admin on Sat Dec 16 16:37:55 GMT 2023 , Edited by admin on Sat Dec 16 16:37:55 GMT 2023

PRIMARY

PUBCHEM

9852558

Created by admin on Sat Dec 16 16:37:55 GMT 2023 , Edited by admin on Sat Dec 16 16:37:55 GMT 2023

PRIMARY

CAS

105760-98-3

Created by admin on Sat Dec 16 16:37:55 GMT 2023 , Edited by admin on Sat Dec 16 16:37:55 GMT 2023

PRIMARY

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Amount:

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					VLN3VGF679

NK-611 FREE ACID

ACTIVE MOIETY

Comments:

DNA inhibitors

Amount: